CID 11052523

2,5-dimethoxy-4-prop-2-enylphenol

Structural Information

Molecular Formula
C11H14O3
SMILES
COC1=CC(=C(C=C1CC=C)OC)O
InChI
InChI=1S/C11H14O3/c1-4-5-8-6-11(14-3)9(12)7-10(8)13-2/h4,6-7,12H,1,5H2,2-3H3
InChIKey
WPWFNFQROATLTG-UHFFFAOYSA-N
Compound name
2,5-dimethoxy-4-prop-2-enylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

194.0943 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.10158 139.9
[M+Na]+ 217.08352 149.1
[M-H]- 193.08702 142.9
[M+NH4]+ 212.12812 159.5
[M+K]+ 233.05746 146.9
[M+H-H2O]+ 177.09156 134.6
[M+HCOO]- 239.09250 163.2
[M+CH3COO]- 253.10815 183.4
[M+Na-2H]- 215.06897 144.6
[M]+ 194.09375 143.6
[M]- 194.09485 143.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe